2-(4-ethoxyphenoxy)ethyl 3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: 2-(4-ethoxyphenoxy)ethyl 3-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: 2-(4-ethoxyphenoxy)ethyl 3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate CAS Name: 3-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]-2-propenoic acid 2-(4-ethoxyphenoxy)ethyl ester IUPAC Name: 2-(4-ethoxyphenoxy)ethyl 3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: 3-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]acrylic acid 2-(4-ethoxyphenoxy)ethyl ester Formula: C30H26N2O5 MolecularWeight: 494.53784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCOC(=O)C=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCOC(=O)C=CC2=CN(N=C2C3=CC4=CC=CC=C4O3)C5=CC=CC=C5

InChI

InChI=1S/C30H26N2O5/c1-2-34-25-13-15-26(16-14-25)35-18-19-36-29(33)17-12-23-21-32(24-9-4-3-5-10-24)31-30(23)28-20-22-8-6-7-11-27(22)37-28/h3-17,20-21H,2,18-19H2,1H3